6-[[(5-azanyl-1,2,3,4-tetrazol-1-yl)amino]methylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(5-azanyl-1,2,3,4-tetrazol-1-yl)amino]methylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(5-aminotetrazol-1-yl)amino]methylene]-4-chloro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[(5-amino-1-tetrazolyl)amino]methylidene]-4-chloro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(5-aminotetrazol-1-yl)amino]methylidene]-4-chlorocyclohexa-2,4-dien-1-one Traditional Name: 6-[[(5-aminotetrazol-1-yl)amino]methylene]-4-chloro-cyclohexa-2,4-dien-1-one Formula: C8H7ClN6O MolecularWeight: 238.63378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CNN2C(=NN=N2)N)C=C1Cl

Isomeric SMILES

C1=CC(=O)C(=CNN2C(=NN=N2)N)C=C1Cl

InChI

InChI=1S/C8H7ClN6O/c9-6-1-2-7(16)5(3-6)4-11-15-8(10)12-13-14-15/h1-4,11H,(H2,10,12,14)